N-[6-[2-(7-methoxy-3-methylimidazo[1,2-a]pyridin-2-yl)ethyl]-1,3-benzoxazol-2-yl]acetamide

C20H20N4O3 — CID 15684593

IUPACN-[6-[2-(7-methoxy-3-methylimidazo[1,2-a]pyridin-2-yl)ethyl]-1,3-benzoxazol-2-yl]acetamide
SMILESCOc1ccn2c(C)c(CCc3ccc4nc(NC(C)=O)oc4c3)nc2c1
InChIInChI=1S/C20H20N4O3/c1-12-16(22-19-11-15(26-3)8-9-24(12)19)6-4-14-5-7-17-18(10-14)27-20(23-17)21-13(2)25/h5,7-11H,4,6H2,1-3H3,(H,21,23,25)
InChIKeyBHTRUAISFPEMHF-UHFFFAOYSA-N
MW364.41 g/mol
LogP3.54
Rot. Bonds5

About N-[6-[2-(7-methoxy-3-methylimidazo[1,2-a]pyridin-2-yl)ethyl]-1,3-benzoxazol-2-yl]acetamide

N-[6-[2-(7-methoxy-3-methylimidazo[1,2-a]pyridin-2-yl)ethyl]-1,3-benzoxazol-2-yl]acetamide (PubChem CID 15684593) has the molecular formula C20H20N4O3 and a molecular weight of 364.41 g/mol. Its IUPAC name is N-[6-[2-(7-methoxy-3-methylimidazo[1,2-a]pyridin-2-yl)ethyl]-1,3-benzoxazol-2-yl]acetamide.

Molecular Properties

Compound NameN-[6-[2-(7-methoxy-3-methylimidazo[1,2-a]pyridin-2-yl)ethyl]-1,3-benzoxazol-2-yl]acetamide
PubChem CID15684593
Molecular FormulaC20H20N4O3
Molecular Weight364.41 g/mol
Exact Mass364.15
IUPAC NameN-[6-[2-(7-methoxy-3-methylimidazo[1,2-a]pyridin-2-yl)ethyl]-1,3-benzoxazol-2-yl]acetamide
SMILESCOc1ccn2c(C)c(CCc3ccc4nc(NC(C)=O)oc4c3)nc2c1
InChIInChI=1S/C20H20N4O3/c1-12-16(22-19-11-15(26-3)8-9-24(12)19)6-4-14-5-7-17-18(10-14)27-20(23-17)21-13(2)25/h5,7-11H,4,6H2,1-3H3,(H,21,23,25)
InChIKeyBHTRUAISFPEMHF-UHFFFAOYSA-N
XLogP3.54
TPSA81.66 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.41
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[6-[2-(7-methoxy-3-methylimidazo[1,2-a]pyridin-2-yl)ethyl]-1,3-benzoxazol-2-yl]acetamide?
The IUPAC name of N-[6-[2-(7-methoxy-3-methylimidazo[1,2-a]pyridin-2-yl)ethyl]-1,3-benzoxazol-2-yl]acetamide (CID 15684593) is N-[6-[2-(7-methoxy-3-methylimidazo[1,2-a]pyridin-2-yl)ethyl]-1,3-benzoxazol-2-yl]acetamide.
What is the SMILES notation for N-[6-[2-(7-methoxy-3-methylimidazo[1,2-a]pyridin-2-yl)ethyl]-1,3-benzoxazol-2-yl]acetamide?
The canonical SMILES for N-[6-[2-(7-methoxy-3-methylimidazo[1,2-a]pyridin-2-yl)ethyl]-1,3-benzoxazol-2-yl]acetamide is COc1ccn2c(C)c(CCc3ccc4nc(NC(C)=O)oc4c3)nc2c1.
What is the InChIKey of N-[6-[2-(7-methoxy-3-methylimidazo[1,2-a]pyridin-2-yl)ethyl]-1,3-benzoxazol-2-yl]acetamide?
The InChIKey is BHTRUAISFPEMHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N4O3/c1-12-16(22-19-11-15(26-3)8-9-24(12)19)6-4-14-5-7-17-18(10-14)27-20(23-17)21-13(2)25/h5,7-11H,4,6H2,1-3H3,(H,21,23,25).
What are the key properties of N-[6-[2-(7-methoxy-3-methylimidazo[1,2-a]pyridin-2-yl)ethyl]-1,3-benzoxazol-2-yl]acetamide?
N-[6-[2-(7-methoxy-3-methylimidazo[1,2-a]pyridin-2-yl)ethyl]-1,3-benzoxazol-2-yl]acetamide has a molecular weight of 364.41 g/mol, XLogP of 3.54, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-[2-(7-methoxy-3-methylimidazo[1,2-a]pyridin-2-yl)ethyl]-1,3-benzoxazol-2-yl]acetamide is sourced from PubChem (CID 15684593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).